Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 3/20 | 0.37 |
| ▸ | MMP13 | P45452 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7935203 | 0.95 | ALDH1A1 (0.43) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7935207 | 0.95 | ALDH1A1 (0.43) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL7362308 | 0.91 | ITGB3 (0.42) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL7362312 | 0.91 | ITGB3 (0.42) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL7367997 | 0.81 | ALDH1A1 (0.40) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| Trifluoroacetic Acid SCHEMBL7924786 | 0.81 | ALDH1A1 (0.40) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL7362706 | 0.77 | ALDH1A1 (0.43) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7935197 | 0.76 | ALDH1A1 (0.42) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7368257 | 0.76 | ALDH1A1 (0.42) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7935199 | 0.76 | ALDH1A1 (0.42) | ITGB3ITGA2BALDH1A1LMNASMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6242600-B1 | ANTIISCHEMIC AGENTS, ANTICOAGULANTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-06-05 | — | — | US | disclosed |
| EP-0970071-A1 | 2-PEPERAZINONE-1-ACETIC ACID DERIVATIVES AND THEIR USE | Takeda Chemical Industries, Ltd. (JP) | 2000-01-12 | — | — | EP | disclosed |
| WO-1998039324-A1 | 2-PEPERAZINONE-1-ACETIC ACID DERIVATIVES AND THEIR USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-11 | — | — | WO | disclosed |